SCHEMBL5289568

SCHEMBL5289568

CCCCc1nnn(CC)c1CCCC

nearest known ligand 0.39

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
MAOB P27338 1/20 0.39
MAOA P21397 2/20 0.35
GRIA1 P42261 1/20 0.33
GRIA2 P42262 1/20 0.33
GRIA3 P42263 1/20 0.33
GRIA4 P48058 1/20 0.33
SLC9A1 P19634 5/20 0.33
NPC1 O15118 1/20 0.32

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL11376520 0.94 MAOB (0.35) MAOBMAOAGRIA1GRIA2GRIA3
SCHEMBL5280553 0.94 MAOB (0.35) MAOBMAOAGRIA1GRIA2GRIA3
SCHEMBL5286216 0.94 MAOB (0.38) MAOBMAOAGRIA1GRIA2GRIA3
SCHEMBL5284389 0.90 MAOB (0.38) MAOBMAOAGRIA1GRIA2GRIA3
SCHEMBL5284856 0.90 MAOB (0.35) MAOBMAOAGRIA1GRIA2GRIA3
SCHEMBL5280775 0.86 SLC9A1 (0.42) MAOBMAOAGRIA4SLC9A1
SCHEMBL5282446 0.86 MAOB (0.41) MAOBMAOAGRIA4SLC9A1
SCHEMBL5279244 0.84 GRIA1 (0.35) MAOBMAOAGRIA1GRIA2GRIA3
SCHEMBL5279843 0.84 MAOB (0.32) MAOBMAOA
SCHEMBL5275627 0.84 MAOB (0.35) MAOBMAOA

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1859781-A2 Brightening and/or colouring agent with triazoles Henkel Kommanditgesellschaft auf Aktien (DE) 2007-11-28 EP disclosed